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Structure paper

TitleStructure-based engineering of minimal proline dehydrogenase domains for inhibitor discovery.
Journal, issue, pagesProtein Eng. Des. Sel., Vol. 35, Year 2022
Publish dateJul 5, 2022 (structure data deposition date)
AuthorsBogner, A.N. / Ji, J. / Tanner, J.J.
External linksProtein Eng. Des. Sel. / PubMed:36448708
MethodsX-ray diffraction
Resolution1.23 - 1.8 Å
Structure data

PDB-8dko:
Minimal PutA proline dehydrogenase domain (design #1) complexed with S-(-)-tetrahydro-2-furoic acid
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-8dkp:
Minimal PutA proline dehydrogenase domain (design #2) complexed with S-(-)-tetrahydro-2-furoic acid
Method: X-RAY DIFFRACTION / Resolution: 1.23 Å

PDB-8dkq:
Minimal PutA proline dehydrogenase domain (design #2) complexed with 2-(Furan-2-yl)acetic acid
Method: X-RAY DIFFRACTION / Resolution: 1.72 Å

Chemicals

ChemComp-FAD:
FLAVIN-ADENINE DINUCLEOTIDE / FAD*YM

ChemComp-TFB:
TETRAHYDROFURAN-2-CARBOXYLIC ACID

ChemComp-HOH:
WATER

ChemComp-SJU:
(furan-2-yl)acetic acid

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

Source
  • sinorhizobium meliloti sm11 (bacteria)
KeywordsOXIDOREDUCTASE / BETA/ALPHA BARREL / FLAVOENZYME / PROLINE CATABOLISM

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